Vitas-M small molecule compound
methyl 2-({3-[(4-chloro-1H-pyrazol-1-yl)methoxy]phenyl}carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
Catalog ID
STL396166
SMILES COC(=O)C1Cc2ccccc2CN1C(=O)c1cccc(c1)OCn1ncc(c1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H20ClN3O4 MW 425.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O4/c1-29-22(28)20-10-15-5-2-3-6-17(15)12-26(20)21(27)16-7-4-8-19(9-16)30-14-25-13-18(23)11-24-25/h2-9,11,13,20H,10,12,14H2,1H3InChIKey
NPKDIOAFUWTSGB-UHFFFAOYSA-NSynonyms
1214162-35-21214162352
COC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC(=CC=C3)OCN4C=C(C=N4)Cl
InChI=1SC22H20ClN3O4c12922(28)201015523617(15)1226(20)21(27)1674819(916)3014251318(23)112425h29111320H101214H21H3
methyl2((3((4chloro1Hpyrazol1yl)methoxy)phenyl)carbonyl)1234tetrahydroisoquinoline3carboxylate
methyl2(3((4chloropyrazol1yl)methoxy)benzoyl)34dihydro1Hisoquinoline3carboxylate
MFCD08557942
ZINC000020606121
ZINC000020606122
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